Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 15/20 | 0.72 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | PGR | P06401 | 12/20 | 0.52 |
| ▸ | NR3C2 | P08235 | 12/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4524698 | 0.84 | NR3C1 (1.00) | NR3C1L3MBTL1PGRNR3C2ALDH1A1 | |
| SCHEMBL4515265 | 0.84 | NR3C1 (1.00) | NR3C1L3MBTL1PGRNR3C2ALDH1A1 | |
| SCHEMBL28620694 | 0.81 | ALDH1A1 (0.71) | NR3C1L3MBTL1ATMALDH1A1CYP1A2 | |
| SCHEMBL28922484 | 0.77 | ALDH1A1 (0.50) | NR3C1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21814326 | 0.77 | NR3C1 (0.58) | NR3C1L3MBTL1PGRNR3C2MEN1 | |
| SCHEMBL21814325 | 0.76 | NR3C1 (0.57) | NR3C1L3MBTL1PGRNR3C2MEN1 | |
| SCHEMBL17847425 | 0.75 | L3MBTL1 (1.00) | NR3C1L3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL9666001 | 0.75 | NR3C1 (0.55) | NR3C1L3MBTL1PGRNR3C2 | |
| SCHEMBL28922034 | 0.73 | ALDH1A1 (0.63) | L3MBTL1ATMALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL28627656 | 0.73 | ALDH1A1 (0.56) | L3MBTL1ATMALDH1A1CYP1A2CYP2C9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113105374-B | Method for synthesizing alkylamine derivative | 西湖大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-113105374-A | Method for synthesizing alkylamine derivative | 西湖大学 | 2021-07-13 | — | — | CN | disclosed |